IBS-ZINC02183036 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 -4.0220 0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0310 -4.6550 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -6.0420 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3100 -6.6830 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4780 -5.9450 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4260 -4.5630 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2050 -3.9170 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8120 -6.6470 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3290 -6.9370 1.7510 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.8700 -7.7460 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4020 -8.0150 0.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5870 -8.1540 3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5720 -8.6320 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8050 -8.7680 1.7440 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.7110 -8.2050 2.4220 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.4810 -9.1000 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1160 -10.5340 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.2420 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 -2.2320 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 -6.6190 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3530 -7.7620 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3410 -3.9880 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1650 -2.8380 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5530 -6.0260 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7230 -7.6010 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5160 -9.0670 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3630 -8.4480 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7740 -10.8720 -1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0820 -10.5660 -1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2340 -11.1860 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 M END